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5-Chloro-1H-pyrrole-2-carboxylic acid, methyl ester
SpectraBase Compound ID DxWrATjZBfN
InChI InChI=1S/C6H6ClNO2/c1-10-6(9)4-2-3-5(7)8-4/h2-3,8H,1H3
InChIKey YXDKRRSLSSBHFH-UHFFFAOYSA-N
Mol Weight 159.57 g/mol
Molecular Formula C6H6ClNO2
Exact Mass 159.008706 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LLewlouhGfJ
Name 5-Chloro-1H-pyrrole-2-carboxylic acid, methyl ester
CAS Registry Number 1757-31-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H6ClNO2
InChI InChI=1S/C6H6ClNO2/c1-10-6(9)4-2-3-5(7)8-4/h2-3,8H,1H3
InChIKey YXDKRRSLSSBHFH-UHFFFAOYSA-N
Molecular Weight 159.572 g/mol
SMILES [nH]1c(ccc1C(=O)OC)Cl
SPLASH splash10-004i-2900000000-3f0f1344bcd7cbd27a9b
Synonyms Methyl 5-chloranyl-1H-pyrrole-2-carboxylate Methyl 5-chloro-1H-pyrrole-2-carboxylate
Wiley ID 1482635